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Information card for entry 4081150
Preview
Coordinates | 4081150.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C61 H63 B Cl2 P2 Ru |
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Calculated formula | C61 H63 B Cl2 P2 Ru |
SMILES | [CH2]1=[CH]2C[P](C(C)C)(C(C)C)[Ru]345612([cH]1[cH]3[cH]4[c]25[c]61cccc2)[P](c1ccccc1)(c1ccccc1)c1ccccc1.c1(ccccc1)[B-](c1ccccc1)(c1ccccc1)c1ccccc1.C(Cl)Cl |
Title of publication | Organoruthenium Complexes Containing New Phosphorus‒Carbon and Phosphorus‒Carbon‒Sulfur Ligands Generated in the Coordination Sphere by Nucleophilic Addition Reactions |
Authors of publication | Garc\?ía de la Arada, Isaac; D\?íez, Josefina; Gamasa, M. Pilar; Lastra, Elena |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 15 |
Pages of publication | 4342 |
a | 10.771 ± 0.005 Å |
b | 11.763 ± 0.005 Å |
c | 20.591 ± 0.005 Å |
α | 89.795 ± 0.005° |
β | 82.923 ± 0.005° |
γ | 82.641 ± 0.005° |
Cell volume | 2567.5 ± 1.7 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0361 |
Residual factor for significantly intense reflections | 0.0318 |
Weighted residual factors for significantly intense reflections | 0.0802 |
Weighted residual factors for all reflections included in the refinement | 0.0836 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
Diffraction radiation wavelength | 1.5418 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4081150.html
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